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(2R,3R)-3-(3-(benzyloxy)-4-methoxyphenyl)-2-methyl-4-nitrobutanal
SpectraBase Compound ID GkvPbMq3NWO
InChI InChI=1S/C19H21NO5/c1-14(12-21)17(11-20(22)23)16-8-9-18(24-2)19(10-16)25-13-15-6-4-3-5-7-15/h3-10,12,14,17H,11,13H2,1-2H3/t14-,17-/m0/s1
InChIKey ABGMJHWVHXWUKB-YOEHRIQHSA-N
Mol Weight 343.38 g/mol
Molecular Formula C19H21NO5
Exact Mass 343.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cc0gbUUpw6v
Name (2R,3R)-3-(3-(benzyloxy)-4-methoxyphenyl)-2-methyl-4-nitrobutanal
Alternate Name(s) (2R,3S)-3-(3-(benzyloxy)-4-methoxyphenyl)-2-methyl-4-nitrobutanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO5
InChI InChI=1S/C19H21NO5/c1-14(12-21)17(11-20(22)23)16-8-9-18(24-2)19(10-16)25-13-15-6-4-3-5-7-15/h3-10,12,14,17H,11,13H2,1-2H3/t14-,17-/m0/s1
InChIKey ABGMJHWVHXWUKB-YOEHRIQHSA-N
Literature Reference DOI 10.1002/adsc.200600640
Molecular Weight 343.379 g/mol
SMILES c1(cc(OCc2ccccc2)c(cc1)OC)[C@]([C@@](C)(C=O)[H])(C[N+](=O)[O-])[H]
SPLASH splash10-0006-9001000000-d0e42960590dbd0f1834
Source of Spectrum ASC-349-1629/SM7-4k
Wiley ID 1765346